Quantum Chemistry
9,538 papers
Quantum Chemistry Research Context
This Quantum Articles category organizes published quantum research papers so readers can browse focused work by topic, source, and year.
Showing 3613-3624 of 9,538
Uncovering piezoelectric effect in polycrystalline diamond membranes.
Jing J, Wang B, Luo Y, Wang Y, Wang Z, Liu Y, Ki DK, Shi X, Wang Q, Li KH, Lin Y, Chu Z
Uncovering the excited-state intramolecular proton transfer and triplet formation pathways of 3-methyl-6-hydroxy-m-phthalic acid.
Bera A, Vennapusa SR
Understanding surface wettability: insights from experiments, molecular simulations, and first-principles theory.
Chowdhury EH, Sohan MSH, Gonzalez-Valle CU, van Duin ACT, Ramos-Alvarado B
Understanding the effects of competing spin-pair dephasing pathways in molecular spins
Timothy J. Krogmeier, James Bradley, Anthony W. Schlimgen, Kade Head-Marsden
Understanding the NO(2) Sensing Mechanism on CdS Quantum Dots via Experimental and First-Principles Calculations.
Zoting KR, Bhoye LN, Kumar A, Jadhav OG, Sabbi VK, Ghule BG, Gholap HM
Understanding the photochemistry of a crystalline push-pull norbornadiene photoswitch.
Hernández FJ, Cox JM, Li J, Lopez S, Crespo-Otero R
Understanding the Propagation Step in a Photoredox Cycloaddition Chain Reaction.
Lee AA, Oo NK, Eaton HT, Fortna CR, Fredin LA, Swierk JR
Unified <i>ab initio</i> quantum-electrodynamical density functional theory for cavity-modified electron-phonon-photon coupling in solids
Benshu Fan, I-Te Lu, Michael Ruggenthaler, Angel Rubio
Unified adiabatic and diabatic excited-state description via the ensemble-variational quantum eigensolver
Christophe Soule, Bruno Senjean, Benjamin Lasorne
Unified Strong-Field Dynamics Simulations from Atoms to Heterostructures
Zakaria Dahbi, Amelle Zaïr
Unified Uncertainty Quantification Framework Bridging Noisy Quantum Backends Across Variational Quantum Algorithms and Quantum Signal Processing
Priyabrata Senapati, Vibin Abraham, Qiang Guan, Bo Peng
Universal logical operations in a silicon quantum processor.
Zhang C, Xu F, Zhang S, Duan M, Zhong D, Bai X, Wang H, Huang C, Deng Y, Gao M, Zhang YN, Liu J, Li C, Jiang Y, Zhao B, Shu H, Wu K, Shi K, Ding Q, Tian Z, Wang G, Yuan X, Xin T, Hu G, Liu S, Pan T, Huang P, He Y, Yu D